[1-(6-ethoxypyridin-3-yl)-5-phenyl-pyrazol-3-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [1-(6-ethoxypyridin-3-yl)-5-phenyl-pyrazol-3-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [1-(6-ethoxy-3-pyridyl)-5-phenyl-pyrazol-3-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [1-(6-ethoxy-3-pyridinyl)-5-phenyl-3-pyrazolyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [1-(6-ethoxypyridin-3-yl)-5-phenylpyrazol-3-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [1-(6-ethoxy-3-pyridyl)-5-phenyl-pyrazol-3-yl]-(4-methylpiperazino)methanone Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)N3CCN(CC3)C)C4=CC=CC=C4

Isomeric SMILES

CCOC1=NC=C(C=C1)N2C(=CC(=N2)C(=O)N3CCN(CC3)C)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5O2/c1-3-29-21-10-9-18(16-23-21)27-20(17-7-5-4-6-8-17)15-19(24-27)22(28)26-13-11-25(2)12-14-26/h4-10,15-16H,3,11-14H2,1-2H3